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1-(2-Bromophenyl)-2-(1H-pyrazol-1-yl)allyl acetate
SpectraBase Compound ID 3MLwsZE5yzw
InChI InChI=1S/C14H13BrN2O2/c1-10(17-9-5-8-16-17)14(19-11(2)18)12-6-3-4-7-13(12)15/h3-9,14H,1H2,2H3
InChIKey AMMQKYYFJSPQPO-UHFFFAOYSA-N
Mol Weight 321.17 g/mol
Molecular Formula C14H13BrN2O2
Exact Mass 320.016041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID rLs7a6NKw3
Name 1-(2-Bromophenyl)-2-(1H-pyrazol-1-yl)allyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13BrN2O2
InChI InChI=1S/C14H13BrN2O2/c1-10(17-9-5-8-16-17)14(19-11(2)18)12-6-3-4-7-13(12)15/h3-9,14H,1H2,2H3
InChIKey AMMQKYYFJSPQPO-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo401867e
Molecular Weight 321.174 g/mol
SMILES c1c(Br)c(ccc1)C(OC(=O)C)C(=C)[n]1nccc1
SPLASH splash10-0zmi-2913000000-431d820240f560a4cbbf
Source of Spectrum J-78-11831-3l
Synonyms Acetic acid [1-(2-bromophenyl)-2-(1-pyrazolyl)prop-2-enyl] ester [1-(2-bromophenyl)-2-pyrazol-1-ylprop-2-enyl] acetate [1-(2-bromophenyl)-2-pyrazol-1-yl-allyl] acetate [1-(2-bromophenyl)-2-pyrazol-1-yl-prop-2-enyl] ethanoate
Wiley ID 1747293